SCHEMBL6808548

SCHEMBL6808548

Brc1ncccn1.CCOC(=O)CCCc1ncccn1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.43
CYP4A11 Q02928 3/20 0.43
LMNA P02545 1/20 0.43
CYP1A2 P05177 3/20 0.42
CYP3A4 P08684 2/20 0.42
CYP2C19 P33261 2/20 0.42
ALOX5 P09917 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TOP2A P11388 1/20 0.41
TBXAS1 P24557 3/20 0.40
CYSLTR2 Q9NS75 1/20 0.40
CYSLTR1 Q9Y271 1/20 0.40
MAPT P10636 1/20 0.40
TNF P01375 3/20 0.39
CYP4Z1 Q86W10 1/20 0.39
CYP4F11 Q9HBI6 1/20 0.39
CYP4F12 Q9HCS2 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL941980 0.92 CYP4F2 (0.49) CYP4F2CYP4A11LMNACYP1A2CYP3A4
SCHEMBL6809067 0.91 LMNA (0.46) CYP4F2CYP4A11LMNACYP1A2CYP3A4
SCHEMBL941705 0.82 CYP4F2 (0.51) CYP4F2CYP4A11LMNASMN1; SMN2TOP2A
SCHEMBL1859504 0.75 CYP1A2 (0.57) CYP4F2CYP4A11LMNACYP1A2CYP3A4
SCHEMBL31193477 0.73 CYP1A2 (0.47) CYP4F2CYP4A11LMNACYP1A2TOP2A
SCHEMBL7890254 0.72 CA12 (0.51) LMNASMN1; SMN2MAPT
SCHEMBL21293608 0.72 CYP1A2 (0.47) CYP4F2CYP4A11LMNACYP1A2CYP3A4
SCHEMBL20224965 0.72 L3MBTL1 (0.51) LMNAALOX5SMN1; SMN2
SCHEMBL20477208 0.71 CYP4F2 (0.48) CYP4F2CYP4A11LMNACYP1A2CYP3A4
SCHEMBL3937555 0.71 SYK (0.50) CYP4F2CYP4A11LMNACYP1A2CYP3A4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040127528-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-07-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040127528-A1 Metalloproteinase inhibitors MMP9, MMP10, MMP3 CYP4F2 709/4885CYP4A11 368/4885LMNA 1461/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.